HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 655415Generated: October 29, 2026
4-Nitrobenzaldehyde → 4-Methyl-1-(4-nitrophenyl)pent-2-yne-1,4-diol
https://huagongshe.com/reaction/655415
Participants
| Role | Name | HCID | Charge |
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| Reactant | 4-Nitrobenzaldehyde | HCID 541 | — |
| Reactant | 2-Methyl-3-butyn-2-ol | HCID 8258 | — |
| Reactant | Butyllithium | HCID 178418339 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Product | 4-Methyl-1-(4-nitrophenyl)pent-2-yne-1,4-diol | HCID 59354776 | 65% |
Reaction Steps
To a stirred −78° C. solution of 2-methylbut-3-yn-2-ol (6.1 mL, 63.5 mmol, 1.2 eq) in dry THF (250 mL), n-BuLi (62 mL, 2.3 M in hexane, 142 mmol, 2.7 eq) was added dropwise over 10 minutes under an inert atmosphere. After being stirred for 40 min at −78° C., a solution of 4-nitrobenzaldehyde (8 g, 52.9 mmol, 1 eq) in dry THF (50 mL) was added to the reaction mixture and stirring was continued for an additional 1 h at −78° C. The reaction mixture was then quenched with a saturated NH4Cl solution and extracted with EtOAc (2×200 mL). The combined organic layers were washed with water (200 mL) and brine (100 mL), dried over Na2SO4, filtered, and concentrated in vacuo. The resulting residue was purified by column chromatography (30% ethyl acetate in hexanes) to afford 4-methyl-1-(4-nitrophenyl)pent-2-yne-1,4-diol (8 g, 65%) as a yellow solid.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08071595B2 |
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| Source dataset | uspto-grants-2011_12 |
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| ORD ID | ord-2531a06588f841a785d9180b53eb60e8 |
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| Source note | uspto-grants-2011_12 |
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